N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide

C19H24N2O5S — CID 57400138

IUPACN-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)N(c2ccccc2)C(C)C)cc1NC(C)=O
InChIInChI=1S/C19H24N2O5S/c1-13(2)21(15-9-7-6-8-10-15)27(23,24)19-11-16(20-14(3)22)17(25-4)12-18(19)26-5/h6-13H,1-5H3,(H,20,22)
InChIKeyVHHGJSMODFCCFA-UHFFFAOYSA-N
MW392.48 g/mol
LogP3.27
Rot. Bonds7

About N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide

N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide (PubChem CID 57400138) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide
PubChem CID57400138
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC NameN-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide
SMILESCOc1cc(OC)c(S(=O)(=O)N(c2ccccc2)C(C)C)cc1NC(C)=O
InChIInChI=1S/C19H24N2O5S/c1-13(2)21(15-9-7-6-8-10-15)27(23,24)19-11-16(20-14(3)22)17(25-4)12-18(19)26-5/h6-13H,1-5H3,(H,20,22)
InChIKeyVHHGJSMODFCCFA-UHFFFAOYSA-N
XLogP3.27
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide (CID 57400138) is N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide is COc1cc(OC)c(S(=O)(=O)N(c2ccccc2)C(C)C)cc1NC(C)=O.
What is the InChIKey of N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is VHHGJSMODFCCFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-13(2)21(15-9-7-6-8-10-15)27(23,24)19-11-16(20-14(3)22)17(25-4)12-18(19)26-5/h6-13H,1-5H3,(H,20,22).
What are the key properties of N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide?
N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 392.48 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-dimethoxy-5-[phenyl(propan-2-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 57400138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).